2-[(5E)-5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]propanedinitrile

Systemtic Name: 2-[(5E)-5-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylidene]-3-ethyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]propanedinitrile Openeye Name: 2-[(5E)-5-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylene]-3-ethyl-4-oxo-thiazolidin-2-ylidene]propanedinitrile CAS Name: 2-[(5E)-5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-ethyl-4-oxo-2-thiazolidinylidene]propanedinitrile IUPAC Name: 2-[(5E)-5-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene]propanedinitrile Traditional Name: 2-[(5E)-5-(3-bromo-4-hydroxy-5-methoxy-benzylidene)-3-ethyl-4-keto-thiazolidin-2-ylidene]malononitrile Formula: C16H12BrN3O3S MolecularWeight: 406.25378

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CC(=C(C(=C2)Br)O)OC)SC1=C(C#N)C#N

Isomeric SMILES

CCN1C(=O)/C(=C\C2=CC(=C(C(=C2)Br)O)OC)/SC1=C(C#N)C#N

InChI

InChI=1S/C16H12BrN3O3S/c1-3-20-15(22)13(24-16(20)10(7-18)8-19)6-9-4-11(17)14(21)12(5-9)23-2/h4-6,21H,3H2,1-2H3/b13-6+